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77085-63-3 | 2(5H)-Furanone,5-undecylidene-, (Z)- (9CI)
CAS No: 77085-63-3 Catalog No: AG0056DN MDL No:
Product Description
Catalog Number:
AG0056DN
Chemical Name:
2(5H)-Furanone,5-undecylidene-, (Z)- (9CI)
CAS Number:
77085-63-3
Molecular Formula:
C15H24O2
Molecular Weight:
236.3499
IUPAC Name:
(5Z)-5-undecylidenefuran-2-one
InChI:
InChI=1S/C15H24O2/c1-2-3-4-5-6-7-8-9-10-11-14-12-13-15(16)17-14/h11-13H,2-10H2,1H3/b14-11-
InChI Key:
QIKKUOPGWZUABH-KAMYIIQDSA-N
SMILES:
CCCCCCCCCC/C=C\1/C=CC(=O)O1
EC Number:
278-610-3
Properties
Complexity:
277
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
236.178g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.355g/mol
Monoisotopic Mass:
236.178g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.8
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